نتایج جستجو برای: electronic band structure

تعداد نتایج: 1850878  

R. Vaziri, S. Jalili

First principle calculations were performed using Density functional theory within the local spin density approximation (LSDA) to understand the electronic properties of Au(100)+TBT system and compare the results with Au(100) and bulk Au properties. Band structure, the total DOS and charge density for these materials are calculated. We found that the HOMO for Au(100)+TBT becomes broader than Au...

Journal: :Journal of Physics: Condensed Matter 2018

Journal: :Le Journal de Physique Colloques 1979

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